TL;DR: 1-(5-Hydroxy-2-phenylpyrazolidin-1-yl)ethanone (CAS 107971-84-6) is a chemical compound with molecular formula C11H14N2O2 and molecular weight 206.10553 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(5-hydroxy-2-phenylpyrazolidin-1-yl)ethanone
Also Known As: 2-acetyl-1-phenyl-3-pyrazolidinol, 1-(5-hydroxy-2-phenylpyrazolidin-1-yl)ethanone, 1-acetyl-2-phenyl-5-hydroxypyrazolidine, 1-acetyl-5-hydroxy-2-phenylpyrazolidine, BAS 01967951
| Molecular Formula | C11H14N2O2 |
| Molecular Weight | 206.10553 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 43.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 206.10553 Da |
| Heavy Atoms | 15 |
| Complexity | 239.0 |
| SMILES | CC(=O)N1C(CCN1C2=CC=CC=C2)O |
| InChIKey | OQQMKPXLNCRTJW-UHFFFAOYSA-N |
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(5-Hydroxy-2-phenylpyrazolidin-1-yl)ethanone. With a topological polar surface area (TPSA) of 43.8 Ų, 1-(5-Hydroxy-2-phenylpyrazolidin-1-yl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(5-Hydroxy-2-phenylpyrazolidin-1-yl)ethanone has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-(5-Hydroxy-2-phenylpyrazolidin-1-yl)ethanone is 107971-84-6.
The molecular formula of 1-(5-Hydroxy-2-phenylpyrazolidin-1-yl)ethanone is C11H14N2O2.
The molecular weight of 1-(5-Hydroxy-2-phenylpyrazolidin-1-yl)ethanone is 206.10553 g/mol.
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